(4-cyanophenyl)methyl-ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: (4-cyanophenyl)methyl-ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: (4-cyanophenyl)methyl-ethyl-[2-(isopropylamino)-2-oxo-ethyl]ammonium CAS Name: (4-cyanophenyl)methyl-ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: (4-cyanophenyl)methyl-ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: (4-cyanobenzyl)-ethyl-[2-(isopropylamino)-2-keto-ethyl]ammonium Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)C#N)CC(=O)NC(C)C

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)C#N)CC(=O)NC(C)C

InChI

InChI=1S/C15H21N3O/c1-4-18(11-15(19)17-12(2)3)10-14-7-5-13(9-16)6-8-14/h5-8,12H,4,10-11H2,1-3H3,(H,17,19)/p+1